trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane

C14H23NOSi — CID 135039296

IUPACtrimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane
SMILESCC(C)C1CO/C(=C2\C=CC=C2[Si](C)(C)C)N1
InChIInChI=1S/C14H23NOSi/c1-10(2)12-9-16-14(15-12)11-7-6-8-13(11)17(3,4)5/h6-8,10,12,15H,9H2,1-5H3/b14-11+
InChIKeyWIKVFDDIEMYODL-SDNWHVSQSA-N
MW249.43 g/mol
LogP3.22
Rot. Bonds2

About trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane

trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane (PubChem CID 135039296) has the molecular formula C14H23NOSi and a molecular weight of 249.43 g/mol. Its IUPAC name is trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane
PubChem CID135039296
Molecular FormulaC14H23NOSi
Molecular Weight249.43 g/mol
Exact Mass249.15
IUPAC Nametrimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane
SMILESCC(C)C1CO/C(=C2\C=CC=C2[Si](C)(C)C)N1
InChIInChI=1S/C14H23NOSi/c1-10(2)12-9-16-14(15-12)11-7-6-8-13(11)17(3,4)5/h6-8,10,12,15H,9H2,1-5H3/b14-11+
InChIKeyWIKVFDDIEMYODL-SDNWHVSQSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.43
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane?
The IUPAC name of trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane (CID 135039296) is trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane.
What is the SMILES notation for trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane?
The canonical SMILES for trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane is CC(C)C1CO/C(=C2\C=CC=C2[Si](C)(C)C)N1.
What is the InChIKey of trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane?
The InChIKey is WIKVFDDIEMYODL-SDNWHVSQSA-N. The full InChI is InChI=1S/C14H23NOSi/c1-10(2)12-9-16-14(15-12)11-7-6-8-13(11)17(3,4)5/h6-8,10,12,15H,9H2,1-5H3/b14-11+.
What are the key properties of trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane?
trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane has a molecular weight of 249.43 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(5E)-5-(4-propan-2-yl-1,3-oxazolidin-2-ylidene)cyclopenta-1,3-dien-1-yl]silane is sourced from PubChem (CID 135039296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).